| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 5th, 2006 | 31 | No |
Popular Name: Ruscogenin Ruscogenin
Find On: PubMed — Wikipedia — Google
CAS Numbers: 472-11-7 , [472-11-7]
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 5.02 | -3.3 | -4.26 | 2 | 4 | 0 | 58 | 430.629 | 0 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z80548-4-O | THP-1 (Acute Monocytic Leukemia Cells) (cluster #4 Of 5), Other | Other | 2270 | 0.25 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z80548 | Z80548 | THP-1 (Acute Monocytic Leukemia Cells) | 2270 | 0.25 | Functional ≤ 10μM |
No pre-computed analogs available. Try a structural similarity search.